SCHEMBL30985284

SCHEMBL30985284

COc1c2ccoc2c(CC(O)C(C)(C)O)c2oc(=O)ccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.71
▸ BACE1 P56817 3/20 0.71
▸ ALDH1A1 P00352 5/20 0.61
▸ CYP3A4 P08684 5/20 0.57
▸ CYP1A2 P05177 4/20 0.57
▸ CYP1A1 P04798 3/20 0.57
▸ CYP1B1 Q16678 3/20 0.57
▸ HPGD P15428 3/20 0.57
▸ POLB P06746 2/20 0.57
▸ ALOX15 P16050 1/20 0.53
▸ ABCB1 P08183 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CA9 Q16790 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ GAA P10253 3/20 0.47
▸ MGAM O43451 2/20 0.47
▸ SI P14410 2/20 0.47
▸ MGAM2 Q2M2H8 2/20 0.47
▸ KCNA2 P16389 2/20 0.45
▸ HSD17B10 Q99714 3/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Byakangelicin SCHEMBL27779458 0.83 KDM4E (1.00) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
Byakangelicin SCHEMBL28985144 0.83 KDM4E (1.00) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
Byakangelicin SCHEMBL29419510 0.83 KDM4E (1.00) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
SCHEMBL29997301 0.80 KDM4E (0.86) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
SCHEMBL6997006 0.78 CYP3A4 (0.69) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
SCHEMBL30303158 0.78 KDM4E (0.70) KDM4EBACE1ALDH1A1CYP3A4HPGD
SCHEMBL29740208 0.78 CYP1B1 (0.69) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
SCHEMBL27916259 0.78 KDM4E (0.70) KDM4EBACE1ALDH1A1CYP3A4HPGD
SCHEMBL16352046 0.78 CYP1B1 (0.69) KDM4EBACE1ALDH1A1CYP3A4CYP1A2
Isopimpinellin SCHEMBL29568822 0.74 CYP3A4 (1.00) KDM4EBACE1ALDH1A1CYP3A4CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638770-A2 PRETREATMENT OF SALT-CONTAINING HYDROLYSATE, PARTICULARLY FOR USE IN FERMENTATION PROCESSES Technische Universität München (DE) 2025-10-29 — — EP disclosed
WO-2024133770-A2 PRETREATMENT OF SALT-CONTAINING HYDROLYSATE, PARTICULARLY FOR USE IN FERMENTATION PROCESSES Technische Universität München (DE) 2024-06-27 — — WO disclosed
EP-4389905-A1 PRETREATMENT OF SALT-CONTAINING HYDROLYSATE, PARTICULARLY FOR USE IN FERMENTATION PROCESSES Technische Universität München (DE) 2024-06-26 — — EP disclosed
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